Text Search
Structure Search

3,9-diazaspiro[5.5]undecan-2-one; trifluoroacetic acid

3,9-diazaspiro[5.5]undecan-2-one; trifluoroacetic acid

CAS: 1914148-54-1

Formula: C11H17F3N2O3

SMILES: OC(=O)C(F)(F)F.O=C1CC2(CCNCC2)CCN1

IUPAC: 3,9-diazaspiro[5.5]undecan-2-one; trifluoroacetic acid

InChI: InChI=1S/C9H16N2O.C2HF3O2/c12-8-7-9(3-6-11-8)1-4-10-5-2-9;3-2(4,5)1(6)7/h10H,1-7H2,(H,11,12);(H,6,7)

Composition: C (46.81%), H (6.07%), F (20.19%), N (9.92%), O (17.00%)

Molar Mass: 282.263

Atom Count: 36

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 282.119126904
Formal Charge 0
FSP3 0.82
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey UNPHVIAXUMVJHN-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 47.11
Topological Polar Surface Area 41.13
Polarizability 18.59
Ring Count 2
Rotatable Bond Count 1

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
AA BLOCKS INC
Purity LeadTime CAS PacketSize UnitPrice
97% <6 Days 1914148-54-1 $102.35-$181.70$102.35$181.70
Request Quote